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109-64-8

Basic Information
CAS No.: 109-64-8
Name: 1,3-Dibromopropane
Article Data: 68
Molecular Structure:
Molecular Structure of 109-64-8 (1,3-Dibromopropane)
Formula: C3H6Br2
Molecular Weight: 201.889
Synonyms: .omega.,.omega.-Dibromopropane;Trimethylene dibromide;propane, 1,3-dibromo-;1/C3H6Br2/c4-2-1-3-5/h1-3H;1,3-Dibromopropane/109-64-8;1,3-Dibromopropane / Trimethylene Dibromide;Trimethylene bromide;
EINECS: 203-690-3
Density: 1.933 g/cm3
Melting Point: -34 °C(lit.)
Boiling Point: 167 °C at 760 mmHg
Flash Point: 54.4 °C
Solubility: 1.7 g/L (30 °C) in water
Appearance: colourless to slightly yellow liquid
Hazard Symbols: IrritantXi
Risk Codes: 10-22-38-51/53-36/37/38
Safety: 16-26-36-61-24/25
Transport Information: UN 1993 3/PG 3
PSA: 0.00000
LogP: 2.16630
Synthetic route
111-35-3

3-ethoxy-1-propanol

109-64-8

1,3-dibromo-propane

Conditions
ConditionsYield
With sulfuric acid; hydrogen bromide for 10h; Heating;91%
17887-80-8

1,3-bis(trimethylsiloxy)propane

109-64-8

1,3-dibromo-propane

Conditions
ConditionsYield
With Tri-n-butylfluorphosphoniumbromid In benzene at 20℃; for 24h;76%
503-30-0

trimethylene oxide

109-64-8

1,3-dibromo-propane

Conditions
ConditionsYield
With hydrogen bromide at 100℃;
78-75-1

1,2-Dibromopropane

109-64-8

1,3-dibromo-propane

Conditions
ConditionsYield
at 240 - 250℃; beim Erhitzen im Rohr;
78-75-1

1,2-Dibromopropane

A

594-16-1

2,2-dibromopropane

B

109-64-8

1,3-dibromo-propane

Conditions
ConditionsYield
beim Erhitzen;
74-98-6

propane

A

78-75-1

1,2-Dibromopropane

B

106-94-5

propyl bromide

C

109-64-8

1,3-dibromo-propane

D

75-26-3

isopropyl bromide

Conditions
ConditionsYield
at 300 - 330℃; Bromierung; weitere Produkte: 2.2-Dibrom-propan, Tribrompropan und Tetrabrompropan;
142-28-9

1,3-Dichloropropane

A

109-70-6

1,3-chlorobromopropane

B

109-64-8

1,3-dibromo-propane

Conditions
ConditionsYield
With ethyl bromide; aluminum tri-bromide at 2 - 5℃;
64-17-5

ethanol

109-70-6

1,3-chlorobromopropane

A

142-28-9

1,3-Dichloropropane

B

109-64-8

1,3-dibromo-propane

109-70-6

1,3-chlorobromopropane

109-64-8

1,3-dibromo-propane

Conditions
ConditionsYield
With aluminium trichloride; hydrogen bromide
110-22-5

diacetyl peroxide

106-95-6

allyl bromide

A

106-98-9

1-butylene

B

74-83-9

methyl bromide

C

157556-86-0

5-bromo-4-(bromomethyl)pent-1-ene

D

109-64-8

1,3-dibromo-propane

Conditions
ConditionsYield
at 90℃; entstehen noch 1.5-Dibrom-2-brommethyl-pentan(?) und CO2;
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    Product Name: 1,3-Dibromopropane CAS: 109-64-8 MF: C3H6Br2 MW: 201.89 EINECS: 203-690-3 Mol File: 109-64-8.mol 1,3-Dibromopropane Structure 1,3-Dibromopropane Chemical Properties Melting point -34 °C (lit.) Boiling point

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Chemistry

The Molecular Structure of Trimethylene bromide (CAS NO.109-64-8):


Empirical Formula: C3H6Br2
Molecular Weight: 201.8877 
IUPAC Name: 1,3-dibromopropane  
Appearance: colourless to slightly yellow liquid
Product Categories: Organics;DIBROMOALKANE;alpha,omega-Bifunctional Alkanes;alpha,omega-Dibromoalkanes;Monofunctional & alpha,omega-Bifunctional Alkanes
Nominal Mass: 200 Da
Average Mass: 201.8877 Da
Monoisotopic Mass: 199.88361 Da
Index of Refraction: 1.513
Molar Refractivity: 31.41 cm3
Molar Volume: 104.4 cm3
Surface Tension: 36 dyne/cm
Density: 1.933 g/cm3
Flash Point: 54.4 °C
Enthalpy of Vaporization: 38.69 kJ/mol
Boiling Point: 167 °C at 760 mmHg
Vapour Pressure: 2.29 mmHg at 25°C 
Storage temp: 2-8°C
Water Solubility: 1.7 g/L (30 ºC)
EINECS: 203-690-3
InChI
InChI=1/C3H6Br2/c4-2-1-3-5/h1-3H2
Smiles
C(CBr)CBr 
Synonyms: AI3-28592 ; CCRIS 6711 ; EINECS 203-690-3 ; HSDB 7408 ; NSC 62663 ; Trimethylene dibromide ; alpha,gamma-Dibromopropane ; Propane, 1,3-dibromo-   

Uses

 Trimethylene bromide (CAS NO.109-64-8) can be used as Pharmaceutical intermediates, synthetic organic intermediates.

Production

 Trimethylene bromide (CAS NO.109-64-8) can be prepared via the free radical addition between hydrogen bromide and allyl bromide .

Toxicity Data With Reference

1.    

mmo-sat 10 µmol/plate

    ENMUDM    Environmental Mutagenesis. 2 (1980),59.
2.    

mma-sat 10 µmol/plate

    ENMUDM    Environmental Mutagenesis. 2 (1980),59.
3.    

ipr-mus LD50:473 mg/kg

    JPCEAO    Journal fuer Praktische Chemie. (Johann Ambrosius Barth Verlag, Postfach 109, DDR-701, Leipzig, Germany) V.1- 1834- 320 (1978),133.
4.    

rec-rbt LDLo:1000 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 34 (1928),223.

Consensus Reports

Reported in EPA TSCA Inventory. EPA Genetic Toxicology Program.

Safety Profile

Moderately toxic by intraperitoneal and rectal routes. Mutation data reported. Irritating and narcotic in high concentration. When heated to decomposition it emits toxic fumes of Br. Used as an herbicide. See also BROMIDES.

Hazard Codes: IrritantXiHarmfulXnDangerousN
Risk Statements: 10-22-38-51/53-36/37/38
R10: Flammable
R22: Harmful if swallowed 
R51/53: Toxic to aquatic organisms, may cause long 
R36/37/38: Irritating to eyes, respiratory system and skin
Safety Statements: 16-26-36-61-24/25
S16: Keep away from sources of ignition - No smoking 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
S36: Wear suitable protective clothing 
S61: Avoid release to the environment. Refer to special instructions safety data sheet
S24/25: Avoid contact with skin and eyes  
RIDADR: UN 1993 3/PG 3

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